3,4,5-trimethoxy-N-[(1R,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[(1R,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-yl-propan-2-yl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[(1S,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 3,4,5-trimethoxy-N-[(1R,2S)-1-(1-pyrrolidin-1-iumyl)-1-thiophen-2-ylpropan-2-yl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[(1R,2S)-1-pyrrolidin-1-ium-1-yl-1-thiophen-2-ylpropan-2-yl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[(1S,2R)-1-methyl-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide Formula: C21H29N2O4S+ MolecularWeight: 405.53096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCCC2)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

C[C@@H]([C@H](C1=CC=CS1)[NH+]2CCCC2)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H28N2O4S/c1-14(19(18-8-7-11-28-18)23-9-5-6-10-23)22-21(24)15-12-16(25-2)20(27-4)17(13-15)26-3/h7-8,11-14,19H,5-6,9-10H2,1-4H3,(H,22,24)/p+1/t14-,19+/m0/s1